E580-0168 Screening compound: N-(2,4-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

E580-0168 Screening compound: N-(2,4-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
E580-0168 Screening compound: N-(2,4-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E580-0168
N-(2,4-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

E580-0168

Molecular Formula

C24H25N3O4S2 (C24 H25 N3 O4 S2)

Compound Name

N-(2,4-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H,4H,6H,7H-thieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide

IUPAC name

N-(24-dimethoxyphenyl)-2-{[4-oxo-3-(2-phenylethyl)-3H4H6H7H-thieno[32-d]pyrimidin-2-yl]sulfanyl}acetamide

SMILES

COc(cc1)cc(OC)c1NC(CSC(N(CCc1ccccc1)C1=O)=NC2=C1SCC2)=O

InChI

InChI=1S/C24H25N3O4S2/c1-30-17-8-9-18(20(14-17)31-2)25-21(28)15-33-24-26-19-11-13-32-22(19)23(29)27(24)12-10-16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3,(H,25,28)

InChI Key

KMXWUVQDUJMQGF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05897491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

483.61

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.359

Distribution Coefficient, logD

3.358

Water Solubility, LogSw

-3.72

Polar Surface Area

63.712

Acid Dissociation Constant (pKa)

11.25

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.20

References: we are preparing a list of scientific research reports with E580-0168 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E580-0168?
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What is the minimum amount of E580-0168 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E580-0168
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E580-0168
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of E580-0168 available by request